2-[7-[[1-(3,5-dimethylphenyl)-3-methyl-butyl]carbamoyl]-1-benzofuran-2-yl]ethanoic acid

Systemtic Name: 2-[7-[[1-(3,5-dimethylphenyl)-3-methyl-butyl]carbamoyl]-1-benzofuran-2-yl]ethanoic acid Openeye Name: 2-[7-[[1-(3,5-dimethylphenyl)-3-methyl-butyl]carbamoyl]benzofuran-2-yl]acetic acid CAS Name: 2-[7-[[[1-(3,5-dimethylphenyl)-3-methylbutyl]amino]-oxomethyl]-2-benzofuranyl]acetic acid IUPAC Name: 2-[7-[[1-(3,5-dimethylphenyl)-3-methylbutyl]carbamoyl]-1-benzofuran-2-yl]acetic acid Traditional Name: 2-[7-[[1-(3,5-dimethylphenyl)-3-methyl-butyl]carbamoyl]benzofuran-2-yl]acetic acid Formula: C24H27NO4 MolecularWeight: 393.47548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(CC(C)C)NC(=O)C2=CC=CC3=C2OC(=C3)CC(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(CC(C)C)NC(=O)C2=CC=CC3=C2OC(=C3)CC(=O)O)C

InChI

InChI=1S/C24H27NO4/c1-14(2)8-21(18-10-15(3)9-16(4)11-18)25-24(28)20-7-5-6-17-12-19(13-22(26)27)29-23(17)20/h5-7,9-12,14,21H,8,13H2,1-4H3,(H,25,28)(H,26,27)